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1227269-17-1 | 1H-Pyrrolo[2,3-c]pyridine, 5,7-dichloro-2-methyl-1-(phenylsulfonyl)-
CAS No: 1227269-17-1 Catalog No: AG000J57 MDL No:
Product Description
Catalog Number:
AG000J57
Chemical Name:
1H-Pyrrolo[2,3-c]pyridine, 5,7-dichloro-2-methyl-1-(phenylsulfonyl)-
CAS Number:
1227269-17-1
Molecular Formula:
C14H10Cl2N2O2S
Molecular Weight:
341.2124
IUPAC Name:
1-(benzenesulfonyl)-5,7-dichloro-2-methylpyrrolo[2,3-c]pyridine
InChI:
InChI=1S/C14H10Cl2N2O2S/c1-9-7-10-8-12(15)17-14(16)13(10)18(9)21(19,20)11-5-3-2-4-6-11/h2-8H,1H3
InChI Key:
FZLVPQXKUATMRJ-UHFFFAOYSA-N
SMILES:
Clc1cc2cc(n(c2c(n1)Cl)S(=O)(=O)c1ccccc1)C
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.984g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.206g/mol
Monoisotopic Mass:
339.984g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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